SCHEMBL6992005

SCHEMBL6992005

FC1(F)Oc2cc3nc[nH]c3cc2OC1(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PRKCI P41743 1/20 0.39
RAD52 P43351 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
MMP12 P39900 1/20 0.36
CYP3A4 P08684 1/20 0.35
NAMPT P43490 1/20 0.35
XDH P47989 1/20 0.35
PSMD11 O00231 1/20 0.33
QPCT Q16769 4/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16789306 0.89 MAPT (0.46) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL6881022 0.75 MAPT (0.50) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL30404833 0.75 MAPT (0.50) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL29408377 0.73 QPCT (0.51) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL1091693 0.73 QPCT (0.51) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL5766962 0.73 MAPT (0.48) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL14511179 0.72 MAPT (0.68) MAPTKDM4EALDH1A1APEX1RECQL
Hydrochloric Acid SCHEMBL9836827 0.72 QPCT (0.50) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL12445185 0.70 MAPT (0.65) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL8043985 0.68 ATP4A (0.36)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230247994-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-10 US disclosed
US-20230247994-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-10 US disclosed
US-20230247994-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-10 US disclosed
EP-4175961-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2023-05-10 EP disclosed
WO-2022002818-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2022-01-06 WO disclosed
US-6638960-B2 Use as microbicides, especially fungicides, in crop protection BAYER AKTIENGESELLSCHAFT (DE) 2003-10-28 US disclosed
EP-0844998-B1 HALOBENZIMIDAZOLES AND THEIR USE AS MICROBICIDES BAYER CROPSCIENCE AG (DE) 2003-04-23 EP disclosed
US-20030027842-A1 Halogenobenzimidazoles ASSMANN LUTZ (DE) 2003-02-06 US disclosed
US-6387939-B1 PLANT SAFENING AGNETS; FUNGICIDE BAYER AKTIENGESELLSCHAFT (DE) 2002-05-14 US disclosed
US-6268508-B1 FOR CROP PROTECTION BAYER AKTIENGESELLSCHAFT (DE) 2001-07-31 US disclosed
US-6160001-A Halobenzimidazoles and their use as microbicides BAYER AKTIENGESELLSCHAFT (DE) 2000-12-12 US disclosed
US-6127547-A FOR CROP PROTECTION; SUCH AS 2-BROMO-6,6-DIFLUORO(1,3)DIOXOLO(4,5-F)BENZIMIDAZOLE BAYER AKTIENGESELLSCHAFT (DE) 2000-10-03 US disclosed
US-6020354-A FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-02-01 US disclosed
EP-0844998-A1 HALOBENZIMIDAZOLES AND THEIR USE AS MICROBICIDES BAYER AG (DE) 1998-06-03 EP disclosed
WO-1997006171-A1 HALOBENZIMIDAZOLES AND THEIR USE AS MICROBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-02-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030027842-A1 Halogenobenzimidazoles MSR1, MRPS23, CBR1 MAPT 4367/4885KDM4E 1295/4885ALDH1A1 1161/4885
US-20230247994-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS CHRM1, DDT, H1-0 MAPT 4309/4885KDM4E 962/4885ALDH1A1 1788/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.